Base information
| Cat. No. | |
| CAS No. | 107534-96-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H22ClN3O |
| Molecular Weight | 307.818 |
| Exact Mass | 307.145 |
| XLogP3 | 3.3415 |
| Mr | 85.3698 |
| PSA | 50.94 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 44 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc(cc1)CCC(C(C)(C)C)(Cn1cncn1)O |
